2-(4-methylphenyl)sulfanyl-6-phenylsulfanyl-hexanoic acid

Systemtic Name: 2-(4-methylphenyl)sulfanyl-6-phenylsulfanyl-hexanoic acid Openeye Name: 6-phenylsulfanyl-2-(p-tolylsulfanyl)hexanoic acid CAS Name: 2-[(4-methylphenyl)thio]-6-(phenylthio)hexanoic acid IUPAC Name: 2-(4-methylphenyl)sulfanyl-6-phenylsulfanylhexanoic acid Traditional Name: 6-(phenylthio)-2-(p-tolylthio)hexanoic acid Formula: C19H22O2S2 MolecularWeight: 346.50678

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC(CCCCSC2=CC=CC=C2)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)SC(CCCCSC2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C19H22O2S2/c1-15-10-12-17(13-11-15)23-18(19(20)21)9-5-6-14-22-16-7-3-2-4-8-16/h2-4,7-8,10-13,18H,5-6,9,14H2,1H3,(H,20,21)